N-[(3-chlorophenyl)methyl]-4-[2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Chemical Structure Depiction of
N-[(3-chlorophenyl)methyl]-4-[2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
N-[(3-chlorophenyl)methyl]-4-[2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide
Compound characteristics
| Compound ID: | K284-3384 |
| Compound Name: | N-[(3-chlorophenyl)methyl]-4-[2-{[2-(2-methoxyanilino)-2-oxoethyl]sulfanyl}-4-oxoquinazolin-3(4H)-yl]butanamide |
| Molecular Weight: | 551.06 |
| Molecular Formula: | C28 H27 Cl N4 O4 S |
| Smiles: | COc1ccccc1NC(CSC1=Nc2ccccc2C(N1CCCC(NCc1cccc(c1)[Cl])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5054 |
| logD: | 3.5054 |
| logSw: | -3.8905 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.303 |
| InChI Key: | SFTXDEXNPUXSBA-UHFFFAOYSA-N |